4-ethyl-6-{5-[2-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-ethyl-6-{5-[2-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}-2H-1,4-benzoxazin-3(4H)-one
4-ethyl-6-{5-[2-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
Compound ID: | L834-0672 |
Compound Name: | 4-ethyl-6-{5-[2-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}-2H-1,4-benzoxazin-3(4H)-one |
Molecular Weight: | 389.33 |
Molecular Formula: | C19 H14 F3 N3 O3 |
Smiles: | CCN1C(COc2ccc(cc12)c1nc(c2ccccc2C(F)(F)F)on1)=O |
Stereo: | ACHIRAL |
logP: | 3.8982 |
logD: | 3.8982 |
logSw: | -4.1023 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 55.47 |
InChI Key: | VFHSJJBTQXJSLL-UHFFFAOYSA-N |